#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jyv s ILE 22 N 0.00 2.32 -0.38 0.58 -1.09 -0.42 -5.01 121.20 117.20 3jyv s ILE 22 Ca 0.00 -1.90 -0.29 0.00 -2.23 0.00 0.00 60.65 56.23 3jyv s ILE 22 Cb 0.00 -2.50 0.01 0.00 -1.58 0.00 0.00 42.46 38.39 3jyv s ILE 22 CO 0.00 -0.27 1.24 -0.13 -1.23 0.00 0.00 174.94 174.55 3jyv s ARG 23 N 1.04 3.82 -0.05 2.79 0.52 -1.26 -3.47 118.95 122.34 3jyv s ARG 23 Ca -0.01 0.96 0.01 0.00 -0.52 0.00 0.00 55.73 56.18 3jyv s ARG 23 Cb -0.20 -3.89 -0.03 0.00 0.52 0.00 0.00 34.95 31.35 3jyv s ARG 23 CO -0.06 -1.25 -0.04 0.42 0.02 0.00 0.00 175.30 174.39 3jyv s ILE 24 N 4.49 3.89 -0.00 1.52 1.09 -1.26 -4.53 121.20 126.40 3jyv s ILE 24 Ca 0.53 -0.49 -0.01 0.00 -1.10 0.00 0.00 60.65 59.58 3jyv s ILE 24 Cb -0.13 -2.64 -0.00 0.00 -1.06 0.00 0.00 42.46 38.63 3jyv s ILE 24 CO 0.26 0.54 0.01 0.28 -0.10 0.00 0.00 174.94 175.93 3jyv s THR 25 N -0.90 0.03 0.10 2.92 -1.32 -0.63 -4.42 115.64 111.42 3jyv s THR 25 Ca 0.14 -0.25 0.10 0.00 -1.21 0.00 0.00 61.69 60.48 3jyv s THR 25 Cb -0.11 -0.11 -0.04 0.00 -1.51 0.00 0.00 72.50 70.73 3jyv s THR 25 CO 0.04 -0.14 -0.26 -0.76 -2.21 0.00 0.00 174.62 171.29 3jyv s LEU 26 N -0.40 2.27 -0.22 9.08 1.02 -0.58 -2.12 118.68 127.72 3jyv s LEU 26 Ca -0.04 -0.69 -0.20 0.00 0.02 0.00 0.00 54.13 53.21 3jyv s LEU 26 Cb -0.03 -1.23 0.06 0.00 0.02 0.00 0.00 46.19 45.01 3jyv s LEU 26 CO -0.00 0.20 0.58 0.28 0.02 0.00 0.00 176.35 177.43 3jyv s THR 27 N -0.97 -0.00 0.08 5.49 -1.32 -1.02 -1.62 115.64 116.29 3jyv s THR 27 Ca 0.13 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.60 3jyv s THR 27 Cb -0.10 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 3jyv s THR 27 CO 0.05 0.00 0.12 -1.54 -2.21 0.00 0.00 174.62 171.03 3jyv n SER 28 N 2.79 -0.33 0.00 8.08 3.41 -0.91 -1.13 113.62 125.53 3jyv n SER 28 Ca -0.14 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 3jyv n SER 28 Cb 0.56 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.12 3jyv n SER 28 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3jyv n THR 29 N -0.14 0.00 -3.65 6.66 -1.04 -1.26 -1.51 114.28 113.34 3jyv n THR 29 Ca 0.00 0.62 0.00 0.00 -2.04 0.00 0.00 64.05 62.63 3jyv n THR 29 Cb 0.14 -1.57 0.00 0.00 -1.82 0.00 0.00 70.33 67.08 3jyv n THR 29 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 3jyv n LYS 30 N -1.92 2.08 0.04 -2.82 3.00 -1.26 -3.81 118.16 113.46 3jyv n LYS 30 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 58.11 3jyv n LYS 30 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.93 3jyv n LYS 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 3jyv h VAL 31 N 0.65 1.28 -0.90 3.15 2.07 -1.98 -3.34 116.25 117.18 3jyv h VAL 31 Ca 0.00 -2.25 0.01 0.00 0.82 0.00 0.00 66.70 65.28 3jyv h VAL 31 Cb 0.00 2.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 3jyv h VAL 31 CO 0.00 0.70 0.60 0.50 0.02 0.00 0.00 177.57 179.38 3jyv h LYS 32 N 0.40 1.18 0.00 1.57 3.64 -2.01 -1.43 116.57 119.91 3jyv h LYS 32 Ca -0.13 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.10 3jyv h LYS 32 Cb 1.69 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 33.23 3jyv h LYS 32 CO 0.20 0.78 -0.50 -0.56 -2.27 0.00 0.00 179.45 177.10 3jyv h GLN 33 N 1.22 0.00 0.09 1.90 -0.00 -2.02 -3.37 115.11 112.93 3jyv h GLN 33 Ca 0.33 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.70 3jyv h GLN 33 Cb -0.14 0.00 0.02 0.00 -0.00 0.00 0.00 27.48 27.36 3jyv h GLN 33 CO -0.07 0.35 -1.17 1.25 -0.00 0.00 0.00 178.83 179.18 3jyv h LEU 34 N 0.00 0.73 -1.01 0.06 5.85 -1.42 -3.26 115.31 116.26 3jyv h LEU 34 Ca -0.02 -0.66 -0.02 0.00 0.84 0.00 0.00 57.88 58.01 3jyv h LEU 34 Cb 1.30 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 3jyv h LEU 34 CO 0.05 1.48 0.38 1.05 -0.34 0.00 0.00 178.44 181.06 3jyv h GLU 35 N 0.24 1.08 -0.01 1.25 4.11 -1.52 -2.29 114.58 117.43 3jyv h GLU 35 Ca -0.15 -0.14 -0.00 0.00 0.07 0.00 0.00 59.36 59.13 3jyv h GLU 35 Cb 1.85 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.89 3jyv h GLU 35 CO 0.22 0.82 -0.01 -0.91 0.07 0.00 0.00 179.01 179.20 3jyv h ASN 36 N 1.07 0.02 0.28 3.06 2.35 -1.75 -2.61 115.58 118.00 3jyv h ASN 36 Ca 0.26 -0.50 -0.12 0.00 -0.55 0.00 0.00 56.30 55.40 3jyv h ASN 36 Cb 0.09 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3jyv h ASN 36 CO -0.04 0.51 -0.49 -0.37 -1.65 0.00 0.00 177.43 175.39 3jyv h VAL 37 N -0.47 1.34 -0.10 2.81 -1.51 -1.59 -1.52 116.25 115.21 3jyv h VAL 37 Ca 0.00 -1.72 -0.06 0.00 -1.23 0.00 0.00 66.70 63.69 3jyv h VAL 37 Cb 0.50 1.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 3jyv h VAL 37 CO 0.00 0.51 -0.19 -1.28 -1.23 0.00 0.00 177.57 175.38 3jyv h SER 38 N 0.19 0.33 0.49 4.19 0.87 -1.47 -3.03 113.55 115.14 3jyv h SER 38 Ca 0.01 -0.56 -0.08 0.00 -1.23 0.00 0.00 61.79 59.93 3jyv h SER 38 Cb 0.94 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 3jyv h SER 38 CO 0.08 0.83 -0.39 -1.28 -0.53 0.00 0.00 176.83 175.54 3jyv h SER 39 N -0.15 0.00 0.64 6.23 0.87 -1.45 -2.97 113.55 116.73 3jyv h SER 39 Ca 0.00 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.45 3jyv h SER 39 Cb 0.77 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 3jyv h SER 39 CO 0.04 0.39 -0.56 -1.13 -0.53 0.00 0.00 176.83 175.05 3jyv h ASN 40 N 0.00 0.00 0.37 6.23 -0.73 -1.24 -2.08 115.58 118.13 3jyv h ASN 40 Ca -0.00 0.00 -0.17 0.00 1.87 0.00 0.00 56.30 58.00 3jyv h ASN 40 Cb 0.74 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.32 3jyv h ASN 40 CO 0.05 0.56 -0.70 0.40 -0.37 0.00 0.00 177.43 177.36 3jyv h ILE 41 N 0.00 1.41 -0.17 2.57 2.04 -1.39 0.13 117.51 122.09 3jyv h ILE 41 Ca -0.01 -2.17 -0.12 0.00 1.00 0.00 0.00 64.86 63.57 3jyv h ILE 41 Cb 1.03 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 3jyv h ILE 41 CO 0.07 0.64 -0.41 0.58 0.00 0.00 0.00 178.15 179.04 3jyv h VAL 42 N 0.20 1.31 0.05 1.67 2.07 -1.53 -2.14 116.25 117.88 3jyv h VAL 42 Ca -0.02 -1.55 -0.07 0.00 0.82 0.00 0.00 66.70 65.88 3jyv h VAL 42 Cb 1.26 1.62 0.01 0.00 -1.52 0.00 0.00 31.29 32.65 3jyv h VAL 42 CO 0.11 0.47 -0.31 0.50 0.02 0.00 0.00 177.57 178.37 3jyv h LYS 43 N 0.33 0.10 0.00 1.57 3.11 -1.18 -3.34 116.57 117.15 3jyv h LYS 43 Ca 0.03 -0.16 -0.16 0.00 -2.81 0.00 0.00 60.65 57.55 3jyv h LYS 43 Cb 0.86 0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 32.13 3jyv h LYS 43 CO 0.07 1.08 -1.08 -1.71 -2.81 0.00 0.00 179.45 175.00 3jyv n ASN 44 N -4.44 1.85 -0.03 4.20 5.15 0.45 -4.50 115.26 117.94 3jyv n ASN 44 Ca -0.12 0.49 -0.15 0.00 -0.60 0.00 0.00 54.58 54.20 3jyv n ASN 44 Cb 0.60 -0.91 -0.10 0.00 -0.53 0.00 0.00 39.78 38.84 3jyv n ASN 44 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3jyv h ALA 45 N -0.73 0.10 -2.52 5.20 0.00 -1.55 -3.44 119.26 116.32 3jyv h ALA 45 Ca -0.24 -0.43 -0.51 0.00 0.00 0.00 0.00 54.91 53.73 3jyv h ALA 45 Cb 1.03 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 3jyv h ALA 45 CO -0.14 0.14 0.15 -2.00 0.00 0.00 0.00 179.25 177.39 3jyv s GLU 46 N -3.58 4.31 0.00 0.00 2.12 -1.00 -4.72 118.70 115.82 3jyv s GLU 46 Ca -0.15 0.95 0.00 0.00 0.36 0.00 0.00 54.97 56.13 3jyv s GLU 46 Cb 0.03 -2.87 0.00 0.00 0.26 0.00 0.00 34.13 31.55 3jyv s GLU 46 CO 0.76 0.38 0.00 0.94 -0.54 0.00 0.00 175.26 176.80 3jyv n GLN 47 N 0.71 0.00 0.00 4.30 7.27 -1.26 -4.53 117.38 123.87 3jyv n GLN 47 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.05 3jyv n GLN 47 Cb 0.51 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.16 3jyv n GLN 47 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 3jyv n HIS 48 N -0.65 0.00 0.17 3.69 8.25 -1.26 -4.86 115.22 120.56 3jyv n HIS 48 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 3jyv n HIS 48 Cb 0.00 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.35 3jyv n HIS 48 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 3jyv h ASN 49 N 0.00 0.00 -3.24 0.41 4.21 -1.96 -3.40 115.58 111.60 3jyv h ASN 49 Ca 0.00 0.00 -0.60 0.00 1.21 0.00 0.00 56.30 56.91 3jyv h ASN 49 Cb 0.00 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 37.09 3jyv h ASN 49 CO 0.00 0.47 -0.41 -0.22 -1.29 0.00 0.00 177.43 175.98 3jyv s LEU 50 N -7.08 4.24 -0.16 1.61 2.96 -1.26 -4.88 118.68 114.11 3jyv s LEU 50 Ca 0.00 0.39 -0.04 0.00 -0.22 0.00 0.00 54.13 54.26 3jyv s LEU 50 Cb 0.11 -2.23 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 3jyv s LEU 50 CO 0.72 0.16 -0.02 0.54 -1.32 0.00 0.00 176.35 176.42 3jyv s VAL 51 N 0.31 4.02 0.20 1.68 0.11 -1.26 -4.08 120.40 121.36 3jyv s VAL 51 Ca 0.13 -0.31 0.03 0.00 -2.93 0.00 0.00 61.98 58.90 3jyv s VAL 51 Cb -0.12 -2.78 -0.03 0.00 -1.53 0.00 0.00 36.38 31.92 3jyv s VAL 51 CO 0.01 0.48 0.33 -0.54 -3.33 0.00 0.00 175.10 172.06 3jyv s LYS 52 N 0.45 3.45 0.27 1.54 1.02 -1.26 -2.40 119.74 122.81 3jyv s LYS 52 Ca -0.02 -0.62 0.25 0.00 0.02 0.00 0.00 55.97 55.60 3jyv s LYS 52 Cb -0.14 -2.91 0.59 0.00 -0.52 0.00 0.00 37.83 34.85 3jyv s LYS 52 CO 0.02 0.46 1.65 1.57 -0.92 0.00 0.00 175.35 178.14 3jyv h LYS 53 N 1.72 0.00 0.00 1.68 2.10 -1.93 -3.46 116.57 116.68 3jyv h LYS 53 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 3jyv h LYS 53 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3jyv h LYS 53 CO 0.66 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.52 3jyv n GLY 54 N 1.24 0.86 3.47 0.07 0.00 -1.25 -4.98 105.19 104.61 3jyv n GLY 54 Ca 0.05 -2.22 -0.43 0.00 0.00 0.00 0.00 46.02 43.42 3jyv n GLY 54 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jyv s PRO 55 N -0.95 3.21 0.65 1.61 0.04 -1.26 -3.72 135.00 134.58 3jyv s PRO 55 Ca 0.00 -0.91 -0.03 0.00 0.04 0.00 0.00 61.00 60.10 3jyv s PRO 55 Cb 0.00 -4.37 0.06 0.00 0.04 0.00 0.00 34.50 30.24 3jyv s PRO 55 CO 0.00 -1.87 0.92 0.54 0.04 0.00 0.00 177.00 176.63 3jyv s VAL 56 N 4.10 2.41 0.00 -0.36 0.11 -1.26 -4.99 120.40 120.41 3jyv s VAL 56 Ca 0.26 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.83 3jyv s VAL 56 Cb -0.14 -2.93 0.00 0.00 -1.53 0.00 0.00 36.38 31.78 3jyv s VAL 56 CO 0.07 0.00 0.00 0.54 -3.33 0.00 0.00 175.10 172.38 3jyv n ARG 57 N -2.69 0.00 0.00 1.54 3.00 -1.26 -4.45 116.66 112.80 3jyv n ARG 57 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.93 3jyv n ARG 57 Cb 0.60 -0.42 0.00 0.00 0.00 0.00 0.00 32.46 32.64 3jyv n ARG 57 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3jyv n LEU 58 N -2.49 0.00 -4.74 0.55 4.32 -1.26 -4.23 117.00 109.15 3jyv n LEU 58 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 56.01 55.68 3jyv n LEU 58 Cb 0.00 0.00 0.11 0.00 -1.62 0.00 0.00 43.42 41.91 3jyv n LEU 58 CO 0.00 0.00 0.71 -2.16 -1.22 0.00 0.00 177.39 174.72 3jyv s PRO 59 N -2.92 1.97 0.42 3.23 0.04 -1.26 -4.94 135.00 131.55 3jyv s PRO 59 Ca 0.00 1.34 -0.23 0.00 0.04 0.00 0.00 61.00 62.15 3jyv s PRO 59 Cb 0.00 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 3jyv s PRO 59 CO 0.00 -1.89 1.06 0.99 0.04 0.00 0.00 177.00 177.21 3jyv s THR 60 N -2.71 3.65 -1.29 1.26 2.01 -1.26 -4.62 115.64 112.69 3jyv s THR 60 Ca 0.64 1.22 -0.13 0.00 0.31 0.00 0.00 61.69 63.73 3jyv s THR 60 Cb -0.20 -3.60 0.13 0.00 0.01 0.00 0.00 72.50 68.84 3jyv s THR 60 CO 0.54 -0.04 1.77 1.17 -0.69 0.00 0.00 174.62 177.37 3jyv n LYS 61 N -0.30 3.36 -3.76 4.92 4.81 -0.91 -4.94 118.16 121.35 3jyv n LYS 61 Ca 0.06 -3.45 -0.20 0.00 -0.87 0.00 0.00 58.31 53.85 3jyv n LYS 61 Cb 0.50 -3.10 -0.02 0.00 0.02 0.00 0.00 35.03 32.42 3jyv n LYS 61 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3jyv s VAL 62 N 1.77 4.33 -0.23 3.15 0.11 -1.26 -3.71 120.40 124.56 3jyv s VAL 62 Ca 0.44 -1.12 -0.03 0.00 -2.93 0.00 0.00 61.98 58.33 3jyv s VAL 62 Cb 0.06 -3.48 0.11 0.00 -1.53 0.00 0.00 36.38 31.54 3jyv s VAL 62 CO 0.00 -0.23 0.29 -0.22 -3.33 0.00 0.00 175.10 171.61 3jyv s LEU 63 N -4.04 -0.32 0.19 2.54 0.20 -1.22 -4.96 118.68 111.08 3jyv s LEU 63 Ca 0.40 -0.15 0.07 0.00 0.69 0.00 0.00 54.13 55.13 3jyv s LEU 63 Cb -0.08 0.66 -0.04 0.00 -0.43 0.00 0.00 46.19 46.30 3jyv s LEU 63 CO 0.29 -0.33 0.06 -0.54 -0.29 0.00 0.00 176.35 175.54 3jyv s LYS 64 N 2.41 2.59 -0.16 1.98 1.02 -1.26 -2.01 119.74 124.31 3jyv s LYS 64 Ca 0.09 -1.07 -0.29 0.00 0.02 0.00 0.00 55.97 54.73 3jyv s LYS 64 Cb -0.15 -2.44 0.09 0.00 -0.52 0.00 0.00 37.83 34.81 3jyv s LYS 64 CO -0.17 0.45 0.84 -1.50 -0.92 0.00 0.00 175.35 174.05 3jyv s ILE 65 N -1.85 0.00 -0.15 2.17 2.07 -1.11 -5.00 121.20 117.32 3jyv s ILE 65 Ca 0.29 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.49 3jyv s ILE 65 Cb -0.09 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.47 3jyv s ILE 65 CO 0.21 0.00 0.00 -0.55 -1.91 0.00 0.00 174.94 172.69 3jyv s SER 66 N -0.63 5.14 0.00 4.50 0.15 -1.26 -1.55 113.70 120.05 3jyv s SER 66 Ca -0.04 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.60 3jyv s SER 66 Cb -0.02 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 3jyv s SER 66 CO 0.03 0.20 0.00 0.35 1.20 0.00 0.00 173.24 175.03 3jyv n THR 67 N 3.31 0.00 -4.10 6.45 -2.24 -1.01 -5.03 114.28 111.66 3jyv n THR 67 Ca -0.17 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.32 3jyv n THR 67 Cb 0.53 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.69 3jyv n THR 67 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3jyv s ARG 68 N 0.56 2.76 -0.13 -0.78 1.81 -1.26 -2.35 118.95 119.56 3jyv s ARG 68 Ca 0.00 -0.84 -0.22 0.00 -1.72 0.00 0.00 55.73 52.95 3jyv s ARG 68 Cb 0.00 -2.61 -0.20 0.00 -0.45 0.00 0.00 34.95 31.68 3jyv s ARG 68 CO 0.00 0.52 0.60 -0.22 -0.68 0.00 0.00 175.30 175.52 3jyv h LYS 69 N 2.93 -0.00 -6.82 3.54 3.64 -1.72 -3.42 116.57 114.71 3jyv h LYS 69 Ca -0.47 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.40 3jyv h LYS 69 Cb 1.18 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.03 3jyv h LYS 69 CO 0.63 0.77 0.52 -0.08 -2.27 0.00 0.00 179.45 179.02 3jyv s THR 70 N -2.08 3.28 -1.93 1.00 -1.32 -1.26 -4.92 115.64 108.41 3jyv s THR 70 Ca -0.15 1.29 0.28 0.00 -1.21 0.00 0.00 61.69 61.90 3jyv s THR 70 Cb -0.02 -3.82 0.46 0.00 -1.51 0.00 0.00 72.50 67.61 3jyv s THR 70 CO 0.54 0.31 1.78 -0.81 -2.21 0.00 0.00 174.62 174.22 3jyv n PRO 71 N 1.13 1.01 0.00 7.08 -0.04 -1.26 -4.89 135.00 138.02 3jyv n PRO 71 Ca -0.01 -0.48 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 3jyv n PRO 71 Cb 0.44 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 3jyv n PRO 71 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3jyv n ASN 72 N -0.58 0.00 0.00 3.54 4.13 -1.26 -5.06 115.26 116.03 3jyv n ASN 72 Ca 0.16 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.42 3jyv n ASN 72 Cb 0.30 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.54 3jyv n ASN 72 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3jyv n GLY 73 N -1.10 0.36 3.70 7.41 0.00 -1.26 -5.06 105.19 109.23 3jyv n GLY 73 Ca 0.00 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 3jyv n GLY 73 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3jyv s GLU 74 N -1.19 4.42 0.00 1.61 1.03 -1.26 -4.70 118.70 118.60 3jyv s GLU 74 Ca 0.00 1.63 0.00 0.00 0.03 0.00 0.00 54.97 56.63 3jyv s GLU 74 Cb 0.00 -3.48 0.00 0.00 -0.80 0.00 0.00 34.13 29.85 3jyv s GLU 74 CO 0.00 -0.31 0.00 0.41 -1.33 0.00 0.00 175.26 174.03 3jyv n GLY 75 N 3.21 -0.22 0.12 -3.83 0.00 -1.26 -4.95 105.19 98.27 3jyv n GLY 75 Ca 0.09 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.36 3jyv n GLY 75 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3jyv h SER 76 N 0.00 0.00 -1.61 1.61 0.02 -1.98 -3.40 113.55 108.19 3jyv h SER 76 Ca 0.00 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 3jyv h SER 76 Cb 0.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.40 3jyv h SER 76 CO 0.00 0.59 1.72 -0.75 -1.14 0.00 0.00 176.83 177.25 3jyv s LYS 77 N -2.91 4.04 -0.23 3.45 2.20 -1.26 -4.85 119.74 120.18 3jyv s LYS 77 Ca 0.02 -2.32 -0.28 0.00 -0.36 0.00 0.00 55.97 53.03 3jyv s LYS 77 Cb 0.08 -5.27 0.14 0.00 -1.51 0.00 0.00 37.83 31.28 3jyv s LYS 77 CO 0.77 -1.98 1.12 -0.08 -0.36 0.00 0.00 175.35 174.82 3jyv s THR 78 N 2.73 0.00 0.08 3.43 -1.32 -1.26 -5.09 115.64 114.20 3jyv s THR 78 Ca 0.47 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 60.90 3jyv s THR 78 Cb 0.00 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.97 3jyv s THR 78 CO 0.03 0.00 0.11 0.26 -2.21 0.00 0.00 174.62 172.81 3jyv s TRP 79 N -0.56 0.33 -0.29 9.09 0.51 -1.26 -3.97 118.94 122.78 3jyv s TRP 79 Ca 0.02 -0.80 -0.10 0.00 -2.12 0.00 0.00 56.10 53.10 3jyv s TRP 79 Cb -0.02 -0.20 0.12 0.00 -0.81 0.00 0.00 33.47 32.56 3jyv s TRP 79 CO -0.04 -0.49 0.64 -2.00 -0.51 0.00 0.00 176.95 174.55 3jyv s GLU 80 N -3.90 0.58 0.13 4.98 2.56 -0.99 -4.17 118.70 117.90 3jyv s GLU 80 Ca 0.07 1.43 -0.12 0.00 0.00 0.00 0.00 54.97 56.35 3jyv s GLU 80 Cb 0.06 0.80 -0.06 0.00 2.00 0.00 0.00 34.13 36.92 3jyv s GLU 80 CO -0.10 -0.20 0.49 -0.08 -0.56 0.00 0.00 175.26 174.82 3jyv s THR 81 N 2.78 4.97 0.13 -1.70 -1.32 -1.26 -2.40 115.64 116.84 3jyv s THR 81 Ca -0.06 0.61 0.05 0.00 -1.21 0.00 0.00 61.69 61.07 3jyv s THR 81 Cb -0.11 -3.68 -0.04 0.00 -1.51 0.00 0.00 72.50 67.15 3jyv s THR 81 CO -0.19 0.20 -0.11 -0.31 -2.21 0.00 0.00 174.62 172.01 3jyv s TYR 82 N -1.50 1.25 0.23 9.09 2.02 -0.59 -5.01 117.35 122.84 3jyv s TYR 82 Ca 0.38 -0.71 -0.10 0.00 -0.37 0.00 0.00 57.07 56.27 3jyv s TYR 82 Cb -0.14 -0.64 -0.01 0.00 -0.40 0.00 0.00 41.96 40.76 3jyv s TYR 82 CO 0.19 0.08 0.39 -1.83 -1.57 0.00 0.00 175.55 172.81 3jyv s GLU 83 N -3.42 1.46 -0.42 -0.62 -1.05 -1.26 -2.76 118.70 110.62 3jyv s GLU 83 Ca 0.14 -1.35 0.02 0.00 -0.15 0.00 0.00 54.97 53.62 3jyv s GLU 83 Cb 0.00 0.42 0.15 0.00 -0.44 0.00 0.00 34.13 34.26 3jyv s GLU 83 CO 0.01 -0.58 0.27 -1.64 0.95 0.00 0.00 175.26 174.27 3jyv s MET 84 N -4.05 1.01 -0.69 -4.83 -1.94 -0.85 -4.95 119.30 102.99 3jyv s MET 84 Ca 0.27 -1.87 -0.27 0.00 -1.71 0.00 0.00 55.69 52.11 3jyv s MET 84 Cb 0.01 -1.82 0.03 0.00 2.01 0.00 0.00 34.83 35.06 3jyv s MET 84 CO 0.10 -1.24 1.32 0.50 -0.01 0.00 0.00 175.02 175.69 3jyv s ARG 85 N 0.43 3.21 -0.40 2.03 3.52 -1.26 -3.37 118.95 123.12 3jyv s ARG 85 Ca 0.22 -0.04 0.03 0.00 -0.13 0.00 0.00 55.73 55.80 3jyv s ARG 85 Cb -0.16 -4.16 0.11 0.00 -1.56 0.00 0.00 34.95 29.17 3jyv s ARG 85 CO -0.05 -2.10 0.13 0.42 -0.81 0.00 0.00 175.30 172.89 3jyv s ILE 86 N 5.88 2.51 -0.38 4.11 1.01 -1.24 -4.66 121.20 128.42 3jyv s ILE 86 Ca 0.40 -2.55 -0.29 0.00 0.00 0.00 0.00 60.65 58.21 3jyv s ILE 86 Cb -0.08 -2.80 0.01 0.00 0.01 0.00 0.00 42.46 39.59 3jyv s ILE 86 CO 0.18 -0.66 1.31 -1.00 0.00 0.00 0.00 174.94 174.76 3jyv s HIS 87 N 0.64 2.61 0.24 3.97 3.76 -0.57 -2.14 115.29 123.80 3jyv s HIS 87 Ca 0.12 0.77 -0.11 0.00 -0.15 0.00 0.00 55.06 55.70 3jyv s HIS 87 Cb -0.21 -4.17 -0.07 0.00 1.11 0.00 0.00 32.58 29.23 3jyv s HIS 87 CO -0.06 -1.70 0.58 -1.59 -0.85 0.00 0.00 174.74 171.13 3jyv s LYS 88 N 4.53 3.85 0.07 1.40 -2.85 -1.26 -2.14 119.74 123.33 3jyv s LYS 88 Ca 0.56 0.35 0.05 0.00 -1.00 0.00 0.00 55.97 55.94 3jyv s LYS 88 Cb -0.13 -2.63 -0.03 0.00 -2.06 0.00 0.00 37.83 32.98 3jyv s LYS 88 CO 0.28 0.30 -0.14 1.03 0.10 0.00 0.00 175.35 176.92 3jyv s ARG 89 N -2.79 0.83 0.00 1.78 1.81 -0.64 -4.69 118.95 115.25 3jyv s ARG 89 Ca 0.48 -0.97 0.00 0.00 -1.72 0.00 0.00 55.73 53.52 3jyv s ARG 89 Cb -0.11 -0.85 0.00 0.00 -0.45 0.00 0.00 34.95 33.54 3jyv s ARG 89 CO 0.20 0.19 0.00 0.98 -0.68 0.00 0.00 175.30 175.99 3jyv n TYR 90 N 1.26 0.00 -2.97 -0.53 4.19 -1.26 -1.53 117.16 116.31 3jyv n TYR 90 Ca -0.21 0.00 -0.13 0.00 3.31 0.00 0.00 57.90 60.87 3jyv n TYR 90 Cb 0.54 -0.18 0.01 0.00 0.49 0.00 0.00 39.34 40.20 3jyv n TYR 90 CO 0.00 0.00 0.00 0.44 0.91 0.00 0.00 176.86 178.21 3jyv n ILE 91 N -2.17 -9.82 -3.20 2.97 -0.00 -1.26 -3.87 119.36 102.00 3jyv n ILE 91 Ca 0.00 0.78 -0.37 0.00 -0.00 0.00 0.00 62.75 63.16 3jyv n ILE 91 Cb 0.00 -6.61 -0.06 0.00 -0.00 0.00 0.00 39.64 32.97 3jyv n ILE 91 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 3jyv s ASP 92 N -2.37 7.03 -0.27 7.28 -1.08 -1.24 -4.55 116.67 121.46 3jyv s ASP 92 Ca 0.27 1.31 -0.06 0.00 -0.52 0.00 0.00 52.55 53.54 3jyv s ASP 92 Cb -0.06 -2.38 -0.00 0.00 -1.46 0.00 0.00 42.92 39.02 3jyv s ASP 92 CO 0.79 0.12 0.06 -0.76 0.52 0.00 0.00 175.17 175.90 3jyv s LEU 93 N -1.69 3.59 0.00 -1.34 1.02 -1.23 -3.67 118.68 115.37 3jyv s LEU 93 Ca 0.38 -0.54 0.00 0.00 0.02 0.00 0.00 54.13 53.98 3jyv s LEU 93 Cb -0.17 -1.87 0.00 0.00 0.02 0.00 0.00 46.19 44.17 3jyv s LEU 93 CO 0.20 -0.13 0.00 1.21 0.02 0.00 0.00 176.35 177.66 3jyv n GLU 94 N 4.87 0.00 -1.88 1.70 4.07 -1.18 -1.30 120.64 126.92 3jyv n GLU 94 Ca -0.15 0.40 -0.43 0.00 -0.06 0.00 0.00 57.16 56.92 3jyv n GLU 94 Cb 0.49 -0.90 -0.03 0.00 -0.06 0.00 0.00 31.44 30.95 3jyv n GLU 94 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3jyv s ALA 95 N -3.14 3.15 -0.26 4.31 0.00 -1.01 -3.57 121.76 121.24 3jyv s ALA 95 Ca 0.00 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.68 3jyv s ALA 95 Cb 0.00 -3.93 0.33 0.00 0.00 0.00 0.00 23.12 19.53 3jyv s ALA 95 CO 0.00 -2.17 1.41 -0.35 0.00 0.00 0.00 175.76 174.66 3jyv n PRO 96 N 8.00 1.74 0.00 0.00 -0.04 -1.26 -4.76 135.00 138.68 3jyv n PRO 96 Ca 0.22 -1.47 0.00 0.00 -0.04 0.00 0.00 63.50 62.21 3jyv n PRO 96 Cb 0.44 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 3jyv n PRO 96 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3jyv n VAL 97 N -0.24 0.00 -0.33 0.52 0.24 -1.26 -4.83 118.33 112.43 3jyv n VAL 97 Ca 0.28 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.65 3jyv n VAL 97 Cb 1.04 -1.07 0.24 0.00 -1.47 0.00 0.00 33.84 32.58 3jyv n VAL 97 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 3jyv h GLN 98 N 0.00 0.80 0.00 7.34 4.15 -1.93 -2.81 115.11 122.66 3jyv h GLN 98 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3jyv h GLN 98 Cb 0.00 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.51 3jyv h GLN 98 CO 0.00 0.53 0.00 0.44 -1.93 0.00 0.00 178.83 177.87 3jyv n ILE 99 N -4.73 0.42 0.75 2.39 -6.64 -1.26 -2.80 119.36 107.49 3jyv n ILE 99 Ca 0.19 0.10 0.13 0.00 -1.77 0.00 0.00 62.75 61.40 3jyv n ILE 99 Cb 0.41 -0.82 0.49 0.00 -1.44 0.00 0.00 39.64 38.28 3jyv n ILE 99 CO 0.00 0.00 0.00 0.55 -1.77 0.00 0.00 176.55 175.33 3jyv n VAL 100 N -1.25 0.40 0.13 7.28 3.14 -1.06 -3.17 118.33 123.80 3jyv n VAL 100 Ca 0.09 -0.11 0.04 0.00 -2.96 0.00 0.00 64.34 61.40 3jyv n VAL 100 Cb 0.13 -0.61 0.02 0.00 -1.06 0.00 0.00 33.84 32.32 3jyv n VAL 100 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 3jyv h LYS 101 N 0.00 0.00 -0.01 1.45 1.63 -1.76 -3.36 116.57 114.52 3jyv h LYS 101 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3jyv h LYS 101 Cb 0.59 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.22 3jyv h LYS 101 CO 0.00 0.34 0.00 2.89 -3.45 0.00 0.00 179.45 179.23 3jyv n ARG 102 N -3.09 1.03 0.25 1.90 1.85 -1.19 -3.01 116.66 114.39 3jyv n ARG 102 Ca -0.00 -0.05 0.13 0.00 -1.00 0.00 0.00 57.85 56.94 3jyv n ARG 102 Cb 0.71 -1.06 0.50 0.00 -1.05 0.00 0.00 32.46 31.56 3jyv n ARG 102 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 3jyv h ILE 103 N 0.08 0.22 0.00 8.89 2.04 -1.80 -3.05 117.51 123.88 3jyv h ILE 103 Ca 0.00 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.00 3jyv h ILE 103 Cb 0.02 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3jyv h ILE 103 CO 0.00 0.09 0.00 0.35 0.00 0.00 0.00 178.15 178.59 3jyv n THR 104 N -3.20 1.18 0.01 -0.27 -2.24 -1.16 -2.34 114.28 106.26 3jyv n THR 104 Ca 0.01 0.31 -0.19 0.00 -2.27 0.00 0.00 64.05 61.91 3jyv n THR 104 Cb 0.40 -1.13 -0.09 0.00 -2.10 0.00 0.00 70.33 67.41 3jyv n THR 104 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3jyv h GLN 105 N 0.00 0.74 -6.05 -0.78 4.20 -1.82 -3.42 115.11 107.98 3jyv h GLN 105 Ca 0.00 -0.70 -0.59 0.00 0.06 0.00 0.00 58.65 57.41 3jyv h GLN 105 Cb 0.21 0.18 -0.09 0.00 0.30 0.00 0.00 27.48 28.07 3jyv h GLN 105 CO 0.00 1.29 0.59 -1.50 -0.67 0.00 0.00 178.83 178.54 3jyv s ILE 106 N -3.51 4.61 -0.02 2.54 2.07 -0.99 -4.80 121.20 121.11 3jyv s ILE 106 Ca -0.10 1.21 0.02 0.00 -1.41 0.00 0.00 60.65 60.37 3jyv s ILE 106 Cb 0.08 -4.32 0.03 0.00 0.13 0.00 0.00 42.46 38.38 3jyv s ILE 106 CO 0.91 -0.50 0.81 0.35 -1.91 0.00 0.00 174.94 174.60 3jyv n THR 107 N 5.92 0.38 -2.59 4.00 -2.24 -1.26 -5.00 114.28 113.48 3jyv n THR 107 Ca 0.07 -0.42 -0.27 0.00 -2.27 0.00 0.00 64.05 61.16 3jyv n THR 107 Cb 0.48 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 3jyv n THR 107 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 3jyv s ILE 108 N -0.49 4.67 -0.45 2.28 2.07 -1.26 -4.65 121.20 123.37 3jyv s ILE 108 Ca 0.04 0.16 -0.09 0.00 -1.41 0.00 0.00 60.65 59.35 3jyv s ILE 108 Cb 0.03 -3.79 0.01 0.00 0.13 0.00 0.00 42.46 38.85 3jyv s ILE 108 CO 0.00 -0.78 0.54 -0.62 -1.91 0.00 0.00 174.94 172.17 3jyv n GLU 109 N -2.32 -1.71 -2.30 3.50 -0.58 -1.26 -4.95 120.64 111.02 3jyv n GLU 109 Ca 0.01 1.70 -0.37 0.00 -0.42 0.00 0.00 57.16 58.08 3jyv n GLU 109 Cb 0.56 -5.06 -0.01 0.00 -0.57 0.00 0.00 31.44 26.35 3jyv n GLU 109 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3jyv s PRO 110 N -2.58 3.84 0.00 3.49 0.04 -1.26 -2.74 135.00 135.79 3jyv s PRO 110 Ca 0.14 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.93 3jyv s PRO 110 Cb -0.04 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.05 3jyv s PRO 110 CO 0.64 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.62 3jyv n GLY 111 N 0.45 1.54 3.67 0.56 0.00 -1.26 -5.04 105.19 105.11 3jyv n GLY 111 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3jyv n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jyv s VAL 112 N -1.86 4.93 -0.39 1.61 1.01 -1.11 -4.21 120.40 120.39 3jyv s VAL 112 Ca 0.00 1.52 -0.13 0.00 0.00 0.00 0.00 61.98 63.37 3jyv s VAL 112 Cb 0.00 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.31 3jyv s VAL 112 CO 0.00 0.07 0.25 -0.62 0.00 0.00 0.00 175.10 174.79 3jyv s ASP 113 N 1.13 5.91 -0.06 3.32 3.68 -0.28 -4.99 116.67 125.38 3jyv s ASP 113 Ca 0.36 -0.90 -0.10 0.00 2.13 0.00 0.00 52.55 54.03 3jyv s ASP 113 Cb -0.17 -2.09 -0.05 0.00 -1.45 0.00 0.00 42.92 39.17 3jyv s ASP 113 CO 0.13 -0.40 0.27 0.68 0.13 0.00 0.00 175.17 175.97 3jyv s VAL 114 N 1.62 5.28 -0.12 1.11 -7.23 -1.26 -2.43 120.40 117.38 3jyv s VAL 114 Ca 0.04 0.49 -0.05 0.00 -1.81 0.00 0.00 61.98 60.64 3jyv s VAL 114 Cb -0.19 -3.55 0.05 0.00 0.56 0.00 0.00 36.38 33.25 3jyv s VAL 114 CO 0.08 0.58 0.26 -0.70 -0.31 0.00 0.00 175.10 175.02 3jyv s GLU 115 N -1.10 0.21 0.00 4.82 2.12 -0.90 -5.05 118.70 118.80 3jyv s GLU 115 Ca 0.20 0.59 0.00 0.00 0.36 0.00 0.00 54.97 56.12 3jyv s GLU 115 Cb -0.14 -0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.15 3jyv s GLU 115 CO 0.09 -0.19 0.10 0.28 -0.54 0.00 0.00 175.26 175.00